ethyl (2E)-4-(4-chlorophenyl)sulfanyl-2-[(4-nitrophenyl)hydrazinylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2E)-4-(4-chlorophenyl)sulfanyl-2-[(4-nitrophenyl)hydrazinylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2E)-4-(4-chlorophenyl)sulfanyl-2-[(4-nitrophenyl)hydrazono]-3-oxo-butanoate CAS Name: (2E)-4-[(4-chlorophenyl)thio]-2-[(4-nitrophenyl)hydrazinylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2E)-4-(4-chlorophenyl)sulfanyl-2-[(4-nitrophenyl)hydrazinylidene]-3-oxobutanoate Traditional Name: (2E)-4-[(4-chlorophenyl)thio]-3-keto-2-[(4-nitrophenyl)hydrazono]butyric acid ethyl ester Formula: C18H16ClN3O5S MolecularWeight: 421.85474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNC1=CC=C(C=C1)[N+](=O)[O-])C(=O)CSC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)/C(=N/NC1=CC=C(C=C1)[N+](=O)[O-])/C(=O)CSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H16ClN3O5S/c1-2-27-18(24)17(16(23)11-28-15-9-3-12(19)4-10-15)21-20-13-5-7-14(8-6-13)22(25)26/h3-10,20H,2,11H2,1H3/b21-17+